N-(methylcarbamoyl)furan-2-carboxamide

C7H8N2O3 — CID 3046478

IUPACN-(methylcarbamoyl)furan-2-carboxamide
SMILESCNC(=O)NC(=O)c1ccco1
InChIInChI=1S/C7H8N2O3/c1-8-7(11)9-6(10)5-3-2-4-12-5/h2-4H,1H3,(H2,8,9,10,11)
InChIKeyUSSJRFIQAVNEJX-UHFFFAOYSA-N
MW168.15 g/mol
LogP0.35
Rot. Bonds1

About N-(methylcarbamoyl)furan-2-carboxamide

N-(methylcarbamoyl)furan-2-carboxamide (PubChem CID 3046478) has the molecular formula C7H8N2O3 and a molecular weight of 168.15 g/mol. Its IUPAC name is N-(methylcarbamoyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(methylcarbamoyl)furan-2-carboxamide
PubChem CID3046478
Molecular FormulaC7H8N2O3
Molecular Weight168.15 g/mol
Exact Mass168.05
IUPAC NameN-(methylcarbamoyl)furan-2-carboxamide
SMILESCNC(=O)NC(=O)c1ccco1
InChIInChI=1S/C7H8N2O3/c1-8-7(11)9-6(10)5-3-2-4-12-5/h2-4H,1H3,(H2,8,9,10,11)
InChIKeyUSSJRFIQAVNEJX-UHFFFAOYSA-N
XLogP0.35
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(methylcarbamoyl)furan-2-carboxamide?
The IUPAC name of N-(methylcarbamoyl)furan-2-carboxamide (CID 3046478) is N-(methylcarbamoyl)furan-2-carboxamide.
What is the SMILES notation for N-(methylcarbamoyl)furan-2-carboxamide?
The canonical SMILES for N-(methylcarbamoyl)furan-2-carboxamide is CNC(=O)NC(=O)c1ccco1.
What is the InChIKey of N-(methylcarbamoyl)furan-2-carboxamide?
The InChIKey is USSJRFIQAVNEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3/c1-8-7(11)9-6(10)5-3-2-4-12-5/h2-4H,1H3,(H2,8,9,10,11).
What are the key properties of N-(methylcarbamoyl)furan-2-carboxamide?
N-(methylcarbamoyl)furan-2-carboxamide has a molecular weight of 168.15 g/mol, XLogP of 0.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylcarbamoyl)furan-2-carboxamide is sourced from PubChem (CID 3046478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).